N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide

Systemtic Name: N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide Openeye Name: N-[4-chloro-3-(1-piperidylsulfonyl)phenyl]-3-(3-fluorophenyl)isoxazole-5-carboxamide CAS Name: N-[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-3-(3-fluorophenyl)-5-isoxazolecarboxamide IUPAC Name: N-(4-chloro-3-piperidin-1-ylsulfonylphenyl)-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide Traditional Name: N-(4-chloro-3-piperidinosulfonyl-phenyl)-3-(3-fluorophenyl)isoxazole-5-carboxamide Formula: C21H19ClFN3O4S MolecularWeight: 463.909663

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3=CC(=NO3)C4=CC(=CC=C4)F)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3=CC(=NO3)C4=CC(=CC=C4)F)Cl

InChI

InChI=1S/C21H19ClFN3O4S/c22-17-8-7-16(12-20(17)31(28,29)26-9-2-1-3-10-26)24-21(27)19-13-18(25-30-19)14-5-4-6-15(23)11-14/h4-8,11-13H,1-3,9-10H2,(H,24,27)